(3α,24E)-3,27-Dihydroxy-9,19-cyclolanost-24-en-26-oic acid

CAS Registry Number®

123563-64-4
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CAS Name

(3α,24E)-3,27-Dihydroxy-9,19-cyclolanost-24-en-26-oic acid

Molecular Formula

C30H48O4

Molecular Mass

472.70

Cite this Page

(3α,24E)-3,27-Dihydroxy-9,19-cyclolanost-24-en-26-oic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=123563-64-4 (retrieved 2024-09-19) (CAS RN: 123563-64-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    205-207 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C30H48O4/c1-19(7-6-8-20(17-31)25(33)34)21-11-13-28(5)23-10-9-22-26(2,3)24(32)12-14-29(22)18-30(23,29)16-15-27(21,28)4/h8,19,21-24,31-32H,6-7,9-18H2,1-5H3,(H,33,34)/b20-8+/t19-,21-,22+,23+,24-,27-,28+,29-,30+/m1/s1

InChIKey

InChIKey=YWPLTMNXKKXXII-CYWJYPAKSA-N

SMILES

C[C@]12[C@]3([C@]4([C@]5(C4)[C@](C(C)(C)[C@H](O)CC5)(CC3)[H])CC[C@]1(C)[C@@]([C@@H](CC/C=C(/C(O)=O)\CO)C)(CC2)[H])[H]

Canonical SMILES

O=C(O)C(=CCCC(C)C1CCC2(C)C3CCC4C(C)(C)C(O)CCC54CC35CCC12C)CO

Other Names for this Substance

  • 9,19-Cyclolanost-24-en-26-oic acid, 3,27-dihydroxy-, (3α,24E)-
  • (3α,24E)-3,27-Dihydroxy-9,19-cyclolanost-24-en-26-oic acid